Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)
TL;DR: Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) (CAS 18465-41-3) is a chemical compound with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-(carbamothioylhydrazinylidene)-2-phenylbutanoic acid
Also Known As: 2-Phenylsuccinaldehydic acid 4-(thiosemicarbazone), Thiosemicarbazone of phenylsuccinic semialdehyde, Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone), (4E)-4-(carbamothioylhydrazinylidene)-2-phenylbutanoic acid, RefChem:1099122
| Molecular Formula | C11H13N3O2S |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 1.0639 |
| Topological Polar Surface Area | 87.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.07285 |
| Heavy Atoms | 17 |
| Complexity | 419.98453 |
Chemical Identifiers
| CAS Number | 18465-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C/C=N/NC(=S)N)C(=O)O |
Product Overview
Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) (CAS 18465-41-3), with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol. IUPAC: (4E)-4-(carbamothioylhydrazinylidene)-2-phenylbutanoic acid.
Chemical Property Profile of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)
Property Insights of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)
The XLogP value of 1.0639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone). The TPSA of 87.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone). Following Lipinski's Rule of Five, Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)?
The CAS number of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) is 18465-41-3.
What is the molecular formula of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)?
The molecular formula of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) is C11H13N3O2S.
What is the molecular weight of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)?
The molecular weight of Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) is 251.07 g/mol.
Where can I buy Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)?
You can request a quote for Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone)?
Yes, KEHONG BIO provides custom synthesis services for Succinaldehydic acid, 2-phenyl-, 4-(thiosemicarbazone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.